CID 134898230

C13H27CrP2 — CID 134898230

IUPAC—
SMILESC=C.CP(C)C.CP(C)C.[CH]1C=CC=C1.[Cr]
InChIInChI=1S/C5H5.2C3H9P.C2H4.Cr/c1-2-4-5-3-1;2*1-4(2)3;1-2;/h1-5H;2*1-3H3;1-2H2;
InChIKeyWUKZECKOUCFKPU-UHFFFAOYSA-N
MW297.30 g/mol
LogP4.83
Rot. Bonds

About CID 134898230

CID 134898230 (PubChem CID 134898230) has the molecular formula C13H27CrP2 and a molecular weight of 297.30 g/mol.

Molecular Properties

Compound NameCID 134898230
PubChem CID134898230
Molecular FormulaC13H27CrP2
Molecular Weight297.30 g/mol
Exact Mass297.10
IUPAC Name—
SMILESC=C.CP(C)C.CP(C)C.[CH]1C=CC=C1.[Cr]
InChIInChI=1S/C5H5.2C3H9P.C2H4.Cr/c1-2-4-5-3-1;2*1-4(2)3;1-2;/h1-5H;2*1-3H3;1-2H2;
InChIKeyWUKZECKOUCFKPU-UHFFFAOYSA-N
XLogP4.83
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.30
LogP ≤ 54.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 134898230?
The IUPAC name of CID 134898230 (CID 134898230) is not available.
What is the SMILES notation for CID 134898230?
The canonical SMILES for CID 134898230 is C=C.CP(C)C.CP(C)C.[CH]1C=CC=C1.[Cr].
What is the InChIKey of CID 134898230?
The InChIKey is WUKZECKOUCFKPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5.2C3H9P.C2H4.Cr/c1-2-4-5-3-1;2*1-4(2)3;1-2;/h1-5H;2*1-3H3;1-2H2;.
What are the key properties of CID 134898230?
CID 134898230 has a molecular weight of 297.30 g/mol, XLogP of 4.83, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 134898230 is sourced from PubChem (CID 134898230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).